N-(4-fluorophenyl)-5-[(2-{[(3-methylphenyl)methyl]amino}-2-oxoethyl)sulfanyl]-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(4-fluorophenyl)-5-[(2-{[(3-methylphenyl)methyl]amino}-2-oxoethyl)sulfanyl]-1,3,4-thiadiazole-2-carboxamide
N-(4-fluorophenyl)-5-[(2-{[(3-methylphenyl)methyl]amino}-2-oxoethyl)sulfanyl]-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F736-0665 |
| Compound Name: | N-(4-fluorophenyl)-5-[(2-{[(3-methylphenyl)methyl]amino}-2-oxoethyl)sulfanyl]-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 416.49 |
| Molecular Formula: | C19 H17 F N4 O2 S2 |
| Smiles: | Cc1cccc(CNC(CSc2nnc(C(Nc3ccc(cc3)F)=O)s2)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.872 |
| logD: | 3.8712 |
| logSw: | -3.9081 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.395 |
| InChI Key: | HIBKXZSFHRDJJN-UHFFFAOYSA-N |